| 2D Structure | |
| CID | 5281743 |
| IUPAC Name | (1R,4Z,6R,7S,17R)-4-ethylidene-7-hydroxy-7-(hydroxymethyl)-6-methyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione |
| InChI | InChI=1S/C18H25NO6/c1-3-12-8-11(2)18(23,10-20)17(22)24-9-13-4-6-19-7-5-14(15(13)19)25-16(12)21/h3-4,11,14-15,20,23H,5-10H2,1-2H3/b12-3-/t11-,14-,15-,18-/m1/s1 |
| InChI Key | BCJMNZRQJAVDLD-CQRYIUNCSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C18H25NO6 |
| Molecular Weight | 351.4 |
| synonyms | ['RETRORSINE', '480-54-6', 'beta-Longilobine', 'XJ86XWL8IY', 'cis-Retronecic acid ester of retronecine', '12,18-Dihydroxy-senecionan-11,16-dione', 'Senecionan-11,16-dione, 12,18-dihydroxy-', 'DTXSID6021242', 'trans-15-Ethylidene-12beta-hydroxy-12alpha-hydroxymethyl-13beta-methylsenec-1-enine', 'NSC-107659', '3-Ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-hydroxymethyl-5-methyl(1,6)dioxacyclododeca(2,3,4-gh)pyrrolizidine-2,7-dione', '(1R,4Z,6R,7S,17R)-4-ethylidene-7-hydroxy-7-(hydroxymethyl)-6-methyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione', '(1R,4Z,6R,7S,17R)-4-ethylidene-7-hydroxy-7-(hydroxymethyl)-6-methyl-2,9-dioxa-14-azatricyclo(9.5.1.014,17)heptadec-11-ene-3,8-dione', 'RefChem:930688', 'DTXCID501242', '610-403-9', '12,18-Dihydroxysenecionan-11,16-dione', 'Retrorsin', '(15Z)-12,18-dihydroxysenecionan-11,16-dione', 'CCRIS 4338', 'HSDB 3530', 'UNII-XJ86XWL8IY', 'NSC 107659', 'Retrorcine', 'Prestwick_562', 'Retrorsine (Standard)', 'RETRORSINE [MI]', 'Prestwick2_000637', 'Prestwick3_000637', 'RETRORSINE [HSDB]', 'RETRORSINE [IARC]', 'BSPBio_000634', 'MLS002153926', 'SCHEMBL133058', 'BPBio1_000698', 'CHEBI:8822', 'CHEMBL496894', 'orb1684265', 'Retrorsine, >=90% (HPLC)', 'HY-N6638R', 'HMS1545M22', 'HMS1569P16', 'HMS2096P16', 'HMS2231J18', 'HY-N6638', 'MSK40320', 'Retrorsine 100 microg/mL in Water', 'AKOS024282552', 'CCG-208491', 'NCGC00142486-03', 'FR161611', 'MS-25432', 'SMR001233270', 'ST057072', 'CS-0062871', 'G12795', 'SR-01000841220', 'SR-01000841220-3', 'BRD-K42142750-001-01-5', 'BRD-K42142750-001-04-9', 'Q27108154', '(Z)-ethylidene-hydroxy-(hydroxymethyl)-methyl-[?]dione', '(1,6)Dioxacyclododecino(2,3,4-gh)pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl-, (3Z,5R,6S,14aR,14bR)-', '(1R,4Z,6R,7S,17R)-4-ethylidene-7-hydroxy-7-(hydroxymethyl)-6-methyl-2,9-dioxa-14-azatricyclo[9.5.1.0??,??]heptadec-11-ene-3,8-dione', '(5R,6S,9a1R,14aR,Z)-3-ethylidene-6-hydroxy-6-(hydroxymethyl)-5-methyl-3,4,5,6,9,9a1,11,13,14,14a-decahydro-[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione', '(7S,1R,6R,17R)-4-ethylidene-7-hydroxy-7-(hydroxymethyl)-6-methyl-2,9-dioxa-14- azatricyclo[9.5.1.0<14,17>]heptadec-11-ene-3,8-dione'] |
From Pubchem