SP-111

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H43NO4
Molecular Weight	469.656
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CCC(C)=C[C@@]1([H])C3=C(OC2(C)C)C=C(CCCCC)C=C3OC(=O)CCCN4CCOCC4

InChI

InChIKey=HAQNKTBQOIAWDB-DNQXCXABSA-N

InChI=1S/C29H43NO4/c1-5-6-7-9-22-19-25(33-27(31)10-8-13-30-14-16-32-17-15-30)28-23-18-21(2)11-12-24(23)29(3,4)34-26(28)20-22/h18-20,23-24H,5-17H2,1-4H3/t23-,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H43NO4
Molecular Weight	469.656
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:12:53 GMT 2023` Edited by `admin` on `Sat Dec 16 11:12:53 GMT 2023`
Record UNII	77FJY4KZ74
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SP-111

Common Name

English

4-MORPHOLINEBUTANOIC ACID, 6A,7,8,10A-TETRAHYDRO-6,6,9-TRIMETHYL-3-PENTYL-6H-DIBENZO(B,D)PYRAN-1-YL ESTER, (6AR-TRANS)-

Systematic Name

English

4-MORPHOLINEBUTANOIC ACID, (6AR,10AR)-6A,7,8,10A-TETRAHYDRO-6,6,9-TRIMETHYL-3-PENTYL-6H-DIBENZO(B,D)PYRAN-1-YL ESTER

Systematic Name

English

Code System Code Type Description

CAS

55602-38-5