APOPTOLIDIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C58H96O21
Molecular Weight	1129.3702
Optical Activity	UNSPECIFIED
Defined Stereocenters	25 / 25
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC[C@@H](C[C@H]1O[C@@](O)([C@H](O)[C@@H]2C[C@H](OC)[C@@H](O)CC\C=C(C)\C=C\[C@@H](O[C@@H]3O[C@@H](C)[C@H](OC)[C@@H](O)[C@@H]3O)[C@H](C)\C=C(C)\C=C(C)\C=C(C)\C(=O)O2)[C@H](C)[C@@H](O)[C@H]1C)O[C@H]4C[C@](C)(O)[C@@H](O[C@H]5C[C@@H](OC)[C@H](O)[C@@H](C)O5)[C@H](C)O4

InChI

InChIKey=WILMROCKORZEMQ-AIUMZUNXSA-N

InChI=1S/C58H96O21/c1-29-17-16-18-40(59)43(69-13)25-45(76-55(65)33(5)23-31(3)21-30(2)22-32(4)41(20-19-29)77-56-51(63)50(62)52(71-15)37(9)74-56)53(64)58(67)35(7)48(60)34(6)42(79-58)24-39(28-68-12)75-47-27-57(11,66)54(38(10)73-47)78-46-26-44(70-14)49(61)36(8)72-46/h17,19-23,32,34-54,56,59-64,66-67H,16,18,24-28H2,1-15H3/b20-19+,29-17+,30-22+,31-21+,33-23+/t32-,34+,35-,36-,37+,38+,39-,40+,41-,42-,43+,44-,45+,46+,47+,48+,49-,50+,51+,52+,53-,54+,56+,57+,58-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C58H96O21
Molecular Weight	1129.3702
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	25 / 25
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:43:15 GMT 2025` Edited by `admin` on `Mon Mar 31 22:43:15 GMT 2025`
Record UNII	SAO6WVQ23I
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

FU-40A

Preferred Name

English

APOPTOLIDIN

Common Name

English

APOPTOLIDIN A

Common Name

English

APOPTOLIDIN [MI]

Common Name

English

Code System Code Type Description

FDA UNII

SAO6WVQ23I