ID: 54349
SMILES:CC1(C)CC(=O)CC2(c3cc(CCCCC)cc(O)c3OC2O)C2C(=O)C1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -15.15
InChIKey:NFNVLALVNHPHIT-UHFFFAOYSA-N
ID: 54350
SMILES:CC(C)C1C2CC(C)=CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.421
InChIKey:JUWPYWCJVBSZRK-UHFFFAOYSA-N
ID: 54351
SMILES:C1(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 54352
SMILES:O=C(Oc1ccccc1C1C(C(=C)C)CCC(C)=C1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -15.401
InChIKey:PSJYJHJHUYXGPL-UHFFFAOYSA-N
ID: 54353
SMILES:C1(C)(C)C2CC3c4c(cc(CCCCC)cc4O)OC(C)(C)C3C(C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.033
InChIKey:QSXIJKXNKNDNAL-UHFFFAOYSA-N
ID: 54354
SMILES:CC(C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 54355
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 54356
SMILES:O=C(C=Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC12)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -16.019
InChIKey:PVTXIUTUSLUBNQ-UHFFFAOYSA-N
ID: 54357
SMILES:C(C)CCc1cc2c(c(O)c1)C1C(C)(CCC(C(C)(O)C)C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.792
InChIKey:MCDULQXRXUXCCT-UHFFFAOYSA-N
ID: 54358
SMILES:C(CCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1=C(C)C)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.358
InChIKey:UIQVAQLUNZEQTA-UHFFFAOYSA-N
ID: 54359
SMILES:C1C(C)(C)C2C(C)(CC1)C(C)(C)Oc1cc(CCCCC)cc(OC(C)=O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -11.976
InChIKey:YAXXCVCOYXUUDQ-UHFFFAOYSA-N
ID: 54360
SMILES:CC(C(C=CC(=O)C)Cc1c(O)c(C(C=Cc2cc(O)c(O)cc2)O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 576.686
CB1 binding score: -11.745
InChIKey:WMJIBXQBTVAARV-UHFFFAOYSA-N
ID: 54361
SMILES:c1(O)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.859
InChIKey:WRBRAMOWKIFTPD-UHFFFAOYSA-N
ID: 54362
SMILES:c1(CCCCC)cc2c(c(O)c1)OC1(C)CCC(C(=C)C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.219
InChIKey:VLTJKSJCCUFHBB-UHFFFAOYSA-N
ID: 54363
SMILES:C1C(c2c(O)cc(CCCCCO)cc2O)C=C(CCC=C(C)C)C(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.997
InChIKey:MXRSWGRQBMRRPY-UHFFFAOYSA-N
ID: 54364
SMILES:C(C(=CCCC1(C)Oc2cc(C(O)CCCC)cc(O)c2C=C1)C)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.502
InChIKey:SVAFDRHECYVCLX-UHFFFAOYSA-N
ID: 54365
SMILES:C(CCC)Cc1c(C(=O)O)c2c3c(c1C)OC(C)(C)C1C2C2CC(CCC12)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.631
InChIKey:MLGMOVIGVQXYES-UHFFFAOYSA-N
ID: 54366
SMILES:O=C1C2C(C)(c3c(O)cc(CCCCC)cc3O1)CCCC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.646
InChIKey:BJBFMUNQQXZBTG-UHFFFAOYSA-N
ID: 54367
SMILES:C(=C(C)CCC=C(C)CCC=C(C)C)Cc1c(O)cc(CCc2ccccc2)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 54368
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1=CC(C)(O)CCC1=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.751
InChIKey:RXNVCGNZWHHVME-UHFFFAOYSA-N
ID: 54369
SMILES:O1C2(C(C)C)CCC3(C)Oc4c(c(O)cc(CCCCC)c4)C13O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.178
InChIKey:GFRDCIDWAXXOEL-UHFFFAOYSA-N