ID: 32992
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)OC(CCCC(C)=C)(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.474
InChIKey:MFBKGRKUFJHJEG-UHFFFAOYSA-N
ID: 32993
SMILES:C1C(C)C2C(c3c(O)cc(CCCCC)cc3O2)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.825
InChIKey:ZOQOWBOVOPMLPU-UHFFFAOYSA-N
ID: 32994
SMILES:CC(C1=C2C(c3c(O)cc(CCC)cc3O2)OC(C)(C)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.558
InChIKey:JGOUVMLPFLMFTG-UHFFFAOYSA-N
ID: 32995
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(OC)cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.382
InChIKey:PIWOIVDTYQHIGV-UHFFFAOYSA-N
ID: 32996
SMILES:CC1(C)C(c2cc(C(CCCCCC)C)ccc2O)C=C(C)CCC1C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.659
CB1 binding score: -15.512
InChIKey:TWDUVQVLDADDHV-UHFFFAOYSA-N
ID: 32997
SMILES:C=C1C2C(C(C)(C)Oc3cc(CCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.367
InChIKey:LMQOCFWCEWKFGS-UHFFFAOYSA-N
ID: 32998
SMILES:O(C(=O)c1ccccc1)CC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.576
CB1 binding score: -18.675
InChIKey:HIDBWRUCPXEWNL-UHFFFAOYSA-N
ID: 32999
SMILES:C1C=C(C)CC2C1C(C)(C)Oc1c2ccc(O)c1C=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.043
InChIKey:ZGWQXGIHSWYNTI-UHFFFAOYSA-N
ID: 33000
SMILES:C(CCC)Cc1ccc(O)c(C2C(C(=C)C)CCC(C)=C2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.247
InChIKey:IJXLDZIYGDHKBA-UHFFFAOYSA-N
ID: 33001
SMILES:c1(O)c2c(cc(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.624
InChIKey:ZZWZWPVQXHMOQM-UHFFFAOYSA-N
ID: 33002
SMILES:CN(C=C(C1CCC(C)=CC1c1c(O)ccc(O)c1)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 287.403
CB1 binding score: -16.092
InChIKey:CJDJTTXLOREXPW-UHFFFAOYSA-N
ID: 33003
SMILES:CC1CC2C(CC1=O)C(C)(C)Oc1c2cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.138
InChIKey:WZJGKXVSMHYLQM-UHFFFAOYSA-N
ID: 33004
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 33005
SMILES:C(C)(=O)Oc1cc2c(c(C(C)CC(C)=C)c1)OC(C)(C)C1CCC(COC(=O)C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -16.049
InChIKey:GUPFFMNYWCPDOI-UHFFFAOYSA-N
ID: 33006
SMILES:c1c(OC)c(OC)c2c(c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.442
InChIKey:QXBKYKHIVHZFSN-UHFFFAOYSA-N
ID: 33007
SMILES:C12(CO)c3c(O)cc(CCCCC)cc3OC3(C)C1OC(C2)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.385
CB1 binding score: -12.246
InChIKey:WNXSLYCALPVNPQ-UHFFFAOYSA-N
ID: 33008
SMILES:Cc1c(C(O)=O)c(O)cc2c1CC(c1c(O)cc(CC)cc1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.418
CB1 binding score: -17.068
InChIKey:SBVFJGBYYXAWTD-UHFFFAOYSA-N
ID: 33009
SMILES:CCCCCc1c(C(=O)O)c(O)c2c(c1)OC(C)C1C(C2)C(C)(C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.378
InChIKey:GYYIBIVNAIEUPC-UHFFFAOYSA-N
ID: 33010
SMILES:Oc1c(C(OC)=O)c(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -17.837
InChIKey:WXUIBYPBAKIMIT-UHFFFAOYSA-N
ID: 33011
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(C(C)(OC)CC2)C(O)C(C)(O)CC1)CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.618
CB1 binding score: -14.127
InChIKey:OUZVNZBPUBSTKN-UHFFFAOYSA-N
ID: 33012
SMILES:c1(CCCCC)cc2c(cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.502
InChIKey:KLPBLQQRVLSPKD-UHFFFAOYSA-N