ID: 18313
SMILES:C(=CCCCc1c2c(c3c(cc2C)OC(C)(C)C2CCC(C)=CC3)(O1)c1c(O)cc(CCCCC)cc1OC2(C)C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 586.857
CB1 binding score: -13.39
InChIKey:MXKGQKNANLEANA-UHFFFAOYSA-N
ID: 18314
SMILES:C1(C)C2(CC1)C(C)(C)Oc1c2c(OC)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -16.88
InChIKey:IEVYYJLUNYUYCI-UHFFFAOYSA-N
ID: 18315
SMILES:C1(C)=CC(c2c(CCCCC)cc(O)cc2O)C(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.586
InChIKey:FMFUQTXYWHLZFT-UHFFFAOYSA-N
ID: 18316
SMILES:c1(C(C)C)cc2c(c(O)c1)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.383
CB1 binding score: -17.389
InChIKey:QBIJVYCFCKYMFV-UHFFFAOYSA-N
ID: 18317
SMILES:C(CC(C)C)CC(C)c1c(O)c(C=O)c(O)c2c1OC(C)(C)C1CCC(C(O)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -16.003
InChIKey:WDKLEKHWADWFJC-UHFFFAOYSA-N
ID: 18318
SMILES:C12(C)Oc3c(c(O)cc(CCCCCC)c3)C3C1(C(=C(C)C)C(=O)C3)OC=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -13.983
InChIKey:ACUAUTVHLHCKFP-UHFFFAOYSA-N
ID: 18319
SMILES:CC1(C)CCCC(=C)C1CCC1(C)Oc2c(O)cc(CCCCC)cc2C(O)=C1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -14.084
InChIKey:YQQVJOYDBBOJRO-UHFFFAOYSA-N
ID: 18320
SMILES:C1C(C(=C)C)C(c2cc(CCCCC)ccc2O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -14.342
InChIKey:SQQVUHYUWDKRKJ-UHFFFAOYSA-N
ID: 18321
SMILES:C1CC2C(c3c(O)cc(CCCCC)cc3OC2(C)C)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 18322
SMILES:CNCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.43
CB1 binding score: -16.915
InChIKey:SBXZZRPUKKXNTP-UHFFFAOYSA-N
ID: 18323
SMILES:C(Cc1cc2c(c(O)c1)C1C(CCC(OC)(C)C1)C(C)(C)O2)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.376
InChIKey:BOMDNYBMHNUAQQ-UHFFFAOYSA-N
ID: 18324
SMILES:O=C(OC)C1=CC2C(C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.26
InChIKey:MGQSXJPDMITCHS-UHFFFAOYSA-N
ID: 18325
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 18326
SMILES:C(O)C1=CC2c3c(O)cc(C)cc3OC(C)(C)C(C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.889
InChIKey:UXQZAOAFFZXRKJ-UHFFFAOYSA-N
ID: 18327
SMILES:OC12C(O)(CC(=C)C3C(C(O)CCO3)O1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.529
CB1 binding score: -13.234
InChIKey:KBEUCFCCQPVBLL-UHFFFAOYSA-N
ID: 18328
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 18329
SMILES:c1(O)c2c(cc(C#Cc3ccccc3)c1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.453
CB1 binding score: -17.358
InChIKey:UPNMCNCYGXAIFV-UHFFFAOYSA-N
ID: 18330
SMILES:c1(CCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -19.932
InChIKey:YRIJETKCLFDWJX-UHFFFAOYSA-N
ID: 18331
SMILES:Oc1c(CC=C(CCC=C(C)C)C)c(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 18332
SMILES:O(P(=O)(O)O)CC(=O)OC(c1c(C)cc2c(c1COC(=O)C)OC(C)(C)C1CCC(C)=CC21)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.52
CB1 binding score: Not available
InChIKey:QJAVAAANLBYKHE-UHFFFAOYSA-N
ID: 18333
SMILES:C(CCCC)c1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -21.398
InChIKey:WPVARKYNWHKQMW-UHFFFAOYSA-N