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3-[(3S,3'S,3a'R,6a'S)-7-chloro-2,4',6'-trioxo-5'-(tetrahydrofuran-2-ylmethyl)-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanoic acid

Catalog ID
STK601900
SMILES OC(=O)CC[C@@H]1N[C@]2([C@@H]3[C@H]1C(=O)N(C3=O)CC1CCCO1)C(=O)Nc1c2cccc1Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H22ClN3O6 MW 447.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3O6/c22-12-5-1-4-11-17(12)23-20(30)21(11)16-15(13(24-21)6-7-14(26)27)18(28)25(19(16)29)9-10-3-2-8-31-10/h1,4-5,10,13,15-16,24H,2-3,6-9H2,(H,23,30)(H,26,27)/t10?,13-,15-,16+,21+/m0/s1
InChIKey
DERHFNHEHXFYBG-FDQVRVBVSA-N
Synonyms
1014023-77-8
1014023778
3((1S3S3aR6aS)7chloro246trioxo5((tetrahydrofuran2yl)methyl)33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((1S3S3aS6aR)7chloro246trioxo5(oxolan2ylmethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)1yl)propanoicacid
3((3S3S3aR6aS)7chloro246trioxo5(tetrahydrofuran2ylmethyl)1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
C1CC(OC1)CN2C(=O)C3C(NC4(C3C2=O)C5=C(C(=CC=C5)Cl)NC4=O)CCC(=O)O
InChI=1SC21H22ClN3O6c22125141117(12)2320(30)21(11)1615(13(2421)6714(26)27)18(28)25(19(16)29)9103283110h1451013151624H2369H2(H2330)(H2627)t10?131516+21+m0s1
MFCD18246150
OC(=O)CC(C@@H)1N(C@)2((C@@H)3(C@H)1C(=O)N(C3=O)CC1CCCO1)C(=O)Nc1c2cccc1Cl
ZINC000009130328
ZINC000009130329

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Available files

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