ID: 19489
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)cc(C)c3)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -18.466
InChIKey:OOSGYAFEZCZRRA-UHFFFAOYSA-N
ID: 19490
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.177
InChIKey:AEOKTSRLUCDOSQ-UHFFFAOYSA-N
ID: 19491
SMILES:C1C2(C)CCC(O)(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C2CC(C)(O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -14.254
InChIKey:XJYWAOGQLYGPBV-UHFFFAOYSA-N
ID: 19492
SMILES:C(CCCCCC)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -17.457
InChIKey:CWXKITARQPOZNY-UHFFFAOYSA-N
ID: 19493
SMILES:c1(O)c(C2(COC(=O)C(C)=CC)OC2)c(OC)cc(CCCC(=CCc2c(OC)c(C)cc(OC)c2)C)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.654
CB1 binding score: -14.748
InChIKey:IROHKLRRDNEXNC-UHFFFAOYSA-N
ID: 19494
SMILES:C1=C(C)CC2C(C1)C(C)(C)Oc1cc(C)c(OC)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.84
InChIKey:ZXRSHEJEBYIBKK-UHFFFAOYSA-N
ID: 19495
SMILES:c1(O)cc(CCCCC)cc(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 19496
SMILES:C(C)(=CCc1c(O)cc(CCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 19497
SMILES:O=Cc1c2c(c(O)cc1C)C(C)(C)Oc1cc(CCCC(=O)O)ccc1OC2C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.508
CB1 binding score: -15.554
InChIKey:URDPFBVMDJBYPX-UHFFFAOYSA-N
ID: 19498
SMILES:c1(CCCC)cc(O)c2c(c1)OC1(C(C)C(O)CC(C(=C)C)C1)C(C(=O)CCCCCCC)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -15.587
InChIKey:SIBCNAKYSYNSJX-UHFFFAOYSA-N
ID: 19499
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 19500
SMILES:c1(CCCCC)cc2c(c(OS(=O)(O)=O)c1)CC(C)=CCCC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.534
CB1 binding score: -15.116
InChIKey:VBZVCVCTBDZKMR-UHFFFAOYSA-N
ID: 19501
SMILES:C1(C(C)C)CC2C(C)(Oc3c2c(OC)cc(CCCCC)c3)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.546
InChIKey:CAFZZCFFJUVNIG-UHFFFAOYSA-N
ID: 19502
SMILES:Cc1cc(=O)cc2c(c1)OC(C)(C)C1C2CC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.349
InChIKey:OVXOPVRPTJMREZ-UHFFFAOYSA-N
ID: 19503
SMILES:O1c2cc(CCCCC)c(C(O)=O)c(O)c2C(=O)C12CC(CC=C(C)C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -14.367
InChIKey:CZXRQBKVHUUJSE-UHFFFAOYSA-N
ID: 19504
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC(=O)C(C)=CC21)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.513
InChIKey:CIJICZZLEOZAJA-UHFFFAOYSA-N
ID: 19505
SMILES:c1c(CCCCC)c2c(c(O)c1)CC1(C(C)CCC3C1C(=C)C(=O)OC3(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -12.951
InChIKey:CMMDETAPAYPDEQ-UHFFFAOYSA-N
ID: 19506
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(=O)O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 19507
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.003
InChIKey:GAJQYHUOJWNZPV-UHFFFAOYSA-N
ID: 19508
SMILES:C(C1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1)(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.791
InChIKey:KYXOJMKHRFYWMG-UHFFFAOYSA-N
ID: 19509
SMILES:c1(O)c2c(c(C(C=C)O)c(C)c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.526
InChIKey:QLOGAWNADWQBKW-UHFFFAOYSA-N