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N-[(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]norvalyl-N~5~-carbamoyl-D-ornithine

Catalog ID
STK575152
SMILES CCCC(C(=O)N[C@@H](C(=O)O)CCCNC(=O)N)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2

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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 C30H38N4O8 MW 582.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H38N4O8/c1-4-8-21(27(36)34-22(28(37)38)10-7-12-32-30(31)40)33-24(35)14-19-15(2)18-13-20-17-9-5-6-11-23(17)41-26(20)16(3)25(18)42-29(19)39/h13,21-22H,4-12,14H2,1-3H3,(H,33,35)(H,34,36)(H,37,38)(H3,31,32,40)/t21?,22-/m1/s1
InChIKey
JJWULMSGEWKVDT-FOIFJWKZSA-N
Synonyms

(2R)2(2(2(411dimethyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)acetamido)pentanamido)5ureidopentanoicacid
(2R)5(carbamoylamino)2(2((2(411dimethyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)acetyl)amino)pentanoylamino)pentanoicacid
CCCC(C(=O)N(C@@H)(C(=O)O)CCCNC(=O)N)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2
CCCC(C(=O)NC(CCCNC(=O)N)C(=O)O)NC(=O)CC1=C(C2=C(C(=C3C(=C2)C4=C(O3)CCCC4)C)OC1=O)C
InChI=1SC30H38N4O8c14821(27(36)3422(28(37)38)107123230(31)40)3324(35)141915(2)181320179561123(17)4126(20)16(3)25(18)4229(19)39h132122H41214H213H3(H3335)(H3436)(H3738)(H3313240)t21?22m1s1
MFCD10488071
N((411dimethyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)acetyl)norvalylN~5~carbamoylDornithine
ZINC000097957025
ZINC000097957026

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Available files

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