NOBILIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H26O5
Molecular Weight	346.4174
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C\C=C(/C)C(=O)O[C@H]1C\C(C)=C\C[C@H](O)C(C)=C[C@@H]2OC(=O)C(=C)[C@H]12

InChI

InChIKey=QFINJHBXXJQKPB-UNYVMELBSA-N

InChI=1S/C20H26O5/c1-6-12(3)19(22)24-16-9-11(2)7-8-15(21)13(4)10-17-18(16)14(5)20(23)25-17/h6-7,10,15-18,21H,5,8-9H2,1-4H3/b11-7+,12-6+,13-10-/t15-,16-,17-,18+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H26O5
Molecular Weight	346.4174
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:35:20 GMT 2025` Edited by `admin` on `Mon Mar 31 19:35:20 GMT 2025`
Record UNII	83EYM5HY0T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NOBILIN

Common Name

English

GERMACRA-1(10),4,11(13)-TRIEN-12-OIC ACID, 3.BETA.,6.BETA.,8.ALPHA.-TRIHYDROXY-, 12,6-LACTONE, 8-(2-METHYLCROTONATE)

Preferred Name

English

2-BUTENOIC ACID, 2-METHYL-, (3AR,4S,6E,9S,10Z,11AS)-2,3,3A,4,5,8,9,11A-OCTAHYDRO-9-HYDROXY-6,10-DIMETHYL-3-METHYLENE-2-OXOCYCLODECA(B)FURAN-4-YL ESTER

Systematic Name

English

Code System Code Type Description

CAS

1674378-92-7

Created by admin on Mon Mar 31 19:35:20 GMT 2025 , Edited by admin on Mon Mar 31 19:35:20 GMT 2025

ALTERNATIVE

CAS

31824-11-0

Created by admin on Mon Mar 31 19:35:20 GMT 2025 , Edited by admin on Mon Mar 31 19:35:20 GMT 2025

PRIMARY

FDA UNII

83EYM5HY0T

Created by admin on Mon Mar 31 19:35:20 GMT 2025 , Edited by admin on Mon Mar 31 19:35:20 GMT 2025

PRIMARY

PUBCHEM

102597438

Created by admin on Mon Mar 31 19:35:20 GMT 2025 , Edited by admin on Mon Mar 31 19:35:20 GMT 2025

PRIMARY

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