PROTOBASSIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H48O6
Molecular Weight	504.6985
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]3(C)C2=CC[C@]4([H])[C@@]5(C)C[C@H](O)[C@H](O)[C@@](C)(CO)[C@]5([H])[C@H](O)C[C@@]34C)C(O)=O

InChI

InChIKey=IDQVFXZQPGAVAM-YPRSBIJBSA-N

InChI=1S/C30H48O6/c1-25(2)9-11-30(24(35)36)12-10-28(5)17(18(30)13-25)7-8-21-26(3)14-20(33)23(34)27(4,16-31)22(26)19(32)15-29(21,28)6/h7,18-23,31-34H,8-16H2,1-6H3,(H,35,36)/t18-,19+,20-,21+,22+,23-,26+,27-,28+,29+,30-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H48O6
Molecular Weight	504.6985
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	11 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:48:50 GMT 2023` Edited by `admin` on `Sat Dec 16 12:48:50 GMT 2023`
Record UNII	QP75M67TBU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PROTOBASSIC ACID

Common Name

English

(4AS,6AR,6AS,6BR,8R,8AR,9R,10R,11S,12AR,14BS)-8,10,11-TRIHYDROXY-9-(HYDROXYMETHYL)-2,2,6A,6B,9,12A-HEXAMETHYL-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-TETRADECAHYDROPICENE-4A-CARBOXYLIC ACID

Systematic Name

English

(2.BETA.,3.BETA.,4.ALPHA.,6.BETA.)-2,3,6,23-TETRAHYDROXYOLEAN-12-EN-28-OIC ACID

Systematic Name

English

PROTOBASSIC-ACID

Common Name

English

OLEAN-12-EN-28-OIC ACID, 2,3,6,23-TETRAHYDROXY-, (2.BETA.,3.BETA.,4.ALPHA.,6.BETA.)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID30958924

Created by admin on Sat Dec 16 12:48:50 GMT 2023 , Edited by admin on Sat Dec 16 12:48:50 GMT 2023

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PUBCHEM

21576541

Created by admin on Sat Dec 16 12:48:50 GMT 2023 , Edited by admin on Sat Dec 16 12:48:50 GMT 2023

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FDA UNII

QP75M67TBU

Created by admin on Sat Dec 16 12:48:50 GMT 2023 , Edited by admin on Sat Dec 16 12:48:50 GMT 2023

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CAS

37905-13-8

Created by admin on Sat Dec 16 12:48:50 GMT 2023 , Edited by admin on Sat Dec 16 12:48:50 GMT 2023

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