RORIDIN A

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H40O9
Molecular Weight	532.6225
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@H]3O[C@]4([H])C=C(C)CC[C@]4(COC(=O)[C@@H](O)[C@H](C)CCO[C@]([H])(\C=C\C=CC(=O)O1)[C@@H](C)O)[C@]2(C)[C@]35CO5

InChI

InChIKey=NSFWWJIQIKBZMJ-PAGWOCKZSA-N

InChI=1S/C29H40O9/c1-17-9-11-28-15-35-26(33)25(32)18(2)10-12-34-20(19(3)30)7-5-6-8-24(31)38-21-14-23(37-22(28)13-17)29(16-36-29)27(21,28)4/h5-8,13,18-23,25,30,32H,9-12,14-16H2,1-4H3/b7-5+,8-6-/t18-,19-,20-,21-,22-,23-,25+,27-,28-,29+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H40O9
Molecular Weight	532.6225
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:50:57 GMT 2023` Edited by `admin` on `Sat Dec 16 08:50:57 GMT 2023`
Record UNII	U28899D1U2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RORIDIN A

Common Name

English

(7'R)-7'-DEOXO-7'-((1R)-1-HYDROXYETHYL)VERRUCARIN A

Common Name

English

NSC-200737

Code

English

VERRUCARIN A, 7'-DEOXO-7'-(1-HYDROXYETHYL)-, (7'R(R))-

Systematic Name

English

RORIDINE A

Common Name

English

VERRUCARIN A, 7'-DEOXO-7'-((1R)-1-HYDROXYETHYL)-, (7'R)-

Systematic Name

English

Code System Code Type Description

FDA UNII

U28899D1U2