ID: 31207
SMILES:CC1(C)C2CCC(C)=CC2c2c(cc(CCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 31208
SMILES:C1(OC(=O)C)CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -16.224
InChIKey:PLRGMXVVVYRZCE-UHFFFAOYSA-N
ID: 31209
SMILES:C(C)(C)CC(O)c1cc(OC)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.632
InChIKey:KPOZPHURHIMSQC-UHFFFAOYSA-N
ID: 31210
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(O)C(C(C)C)(CC2=O)CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.929
InChIKey:SVXGPOAWKGOGMX-UHFFFAOYSA-N
ID: 31211
SMILES:C1(=C)CC2C(C(C)(C)Oc3c2c(O)cc(CCC)c3)C(=O)C=C(C)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -16.27
InChIKey:ALIZDRYFEBKFOB-UHFFFAOYSA-N
ID: 31212
SMILES:C1(CO)=CC2C(CC1)C(C)(C)Oc1cc(CCc3ccccc3)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -16.146
InChIKey:WRZFOUWZUHOJFS-UHFFFAOYSA-N
ID: 31213
SMILES:C(CC)(C(=O)c1c2c(c(O)cc1CCCCC)CC1C(C)(C)CCCC1(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -13.827
InChIKey:MLUSEMHJKCRMQE-UHFFFAOYSA-N
ID: 31214
SMILES:c1c(CCCCC)cc2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 31215
SMILES:C(O)(Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.369
InChIKey:IBKWCSMQQMNHPC-UHFFFAOYSA-N
ID: 31216
SMILES:O(c1c2c(c(C(c3cc(OC)cc(CC=C)c3)=O)c(OC(C(C)C)=O)c1)OC(C)(C)C1CCC(C)=CC21)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.66
CB1 binding score: -16.438
InChIKey:GRWAVRZMRDBFBE-UHFFFAOYSA-N
ID: 31217
SMILES:C(Cc1cc(O)c(C2OC(C(C)(C)OC)CC2)cc1)CC(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.472
CB1 binding score: -15.034
InChIKey:IZJIHNZDJVKJMV-UHFFFAOYSA-N
ID: 31218
SMILES:Oc1cc(CCCC)cc2c1C1CC(=C)C(O)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.479
InChIKey:AVPHSNLWLCPBTR-UHFFFAOYSA-N
ID: 31219
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 31220
SMILES:C1C(C(OC)=O)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 31221
SMILES:c1c(O)c2c(cc1)OC(C)(C)C1CCC(C)C(=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -15.972
InChIKey:ABTLZMLJKJVUSU-UHFFFAOYSA-N
ID: 31222
SMILES:CC(C)C1C2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(CC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.362
InChIKey:VDRHAQXUNUGOFQ-UHFFFAOYSA-N
ID: 31223
SMILES:O=C1C(=O)C(C)=CC2C1C(C)(C)Oc1cc(CCCCC)cc(OC)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.931
InChIKey:ICUJOKSAIBPAPI-UHFFFAOYSA-N
ID: 31224
SMILES:C(C1C(C)C1)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.68
InChIKey:DWFYOFIVZVCIMN-UHFFFAOYSA-N
ID: 31225
SMILES:C(CCCC(C)C)(C)c1cc2c(c(O)c1)C1C(C)(CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 342.523
CB1 binding score: -14.146
InChIKey:XAKWGIFFANWGQA-UHFFFAOYSA-N
ID: 31226
SMILES:c12c(c(C(C)C)cc(O)c1OC)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.312
InChIKey:RNOKZVUUBSKGBL-UHFFFAOYSA-N
ID: 31227
SMILES:CCCCCc1c(C(O)=O)c(C)c(O)c2c1OC1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.577
InChIKey:SKNXEMUCJRNNJJ-UHFFFAOYSA-N