MARASMIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H18O4
Molecular Weight	262.301
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1(C)C[C@H]2C=C(C=O)[C@]34C[C@@]3([C@H]2C1)C(=O)O[C@@H]4O

InChI

InChIKey=BIUVCPLWWOLECJ-WMABBAGQSA-N

InChI=1S/C15H18O4/c1-13(2)4-8-3-9(6-16)14-7-15(14,10(8)5-13)12(18)19-11(14)17/h3,6,8,10-11,17H,4-5,7H2,1-2H3/t8-,10+,11+,14+,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H18O4
Molecular Weight	262.301
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 16:30:04 GMT 2025` Edited by `admin` on `Tue Apr 01 16:30:04 GMT 2025`
Record UNII	S74EQ59M5C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MARASMIC ACID

Common Name

English

NSC-318506

Preferred Name

English

3H,6H-3A,8B-METHANO-1H-INDENO(4,5-C)FURAN-4-CARBOXALDEHYDE, 5A,7,8,8A-TETRAHYDRO-3-HYDROXY-7,7-DIMETHYL-1-OXO-, (3S-(3.ALPHA.,3A.BETA.,5A.BETA.,8A.BETA.,8B.BETA.))-

Systematic Name

English

(3S,3AR,5AS,8AS,8BS)-5A,7,8,8A-TETRAHYDRO-3-HYDROXY-7,7-DIMETHYL-1-OXO-3H,6H-3A,8B-METHANO-1H-INDENO(4,5-C)FURAN-4-CARBOXALDEHYDE

Systematic Name

English

3H,6H-3A,8B-METHANO-1H-INDENO(4,5-C)FURAN-4-CARBOXALDEHYDE, 5A,7,8,8A-TETRAHYDRO-3-HYDROXY-7,7-DIMETHYL-1-OXO-, (3S,3AR,5AS,8AS,8BS)-

Systematic Name

English

Code System Code Type Description

CAS

2212-99-9