ID: 42316
SMILES:c1cc2c(c(O)c1)CC1CC(C(C)=C)C(c3c(O)cc(CCCCC)cc3O1)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.566
CB1 binding score: -12.765
InChIKey:LFASYIKGVIPULV-UHFFFAOYSA-N
ID: 42317
SMILES:O1c2cc(CO)cc(O)c2C2C=C(C)C(=O)CC2C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -12.717
InChIKey:MESZOKOHFKRBOQ-UHFFFAOYSA-N
ID: 42318
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C2C3(C(O)(C)CCC2C(C)(C)O3)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -16.044
InChIKey:LCKLQRUOBLSXQF-UHFFFAOYSA-N
ID: 42319
SMILES:C1CC(C)CC2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 42320
SMILES:C1CC2(c3c(O)cc(CCCCC)c(C=O)c3OC3C=C(C(CCC=C(C)C)(O)C)OC32)OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.66
CB1 binding score: -16.332
InChIKey:RMSMYQATFHFREL-UHFFFAOYSA-N
ID: 42321
SMILES:C(C(c1c(O)c(C=O)c2c(c1)C1C=C(C)CCC1C(C)(C)O2)=O)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -13.491
InChIKey:PJEMQCLHCCGVGI-UHFFFAOYSA-N
ID: 42322
SMILES:CC1(CCCc2cc3c(c(O)c2)CC(O)C(C)(C)O3)C=CC(=C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.078
InChIKey:MKXYGYAAWQRFJN-UHFFFAOYSA-N
ID: 42323
SMILES:c12c(c(OC)cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.651
InChIKey:WHHGTWRLWIUHHT-UHFFFAOYSA-N
ID: 42324
SMILES:c1(CCCC(=C)C)cc(C2C=C(C)CCC2C(=O)C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -13.737
InChIKey:LHXCFLSONVXTAU-UHFFFAOYSA-N
ID: 42325
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 42326
SMILES:C1(C=O)C(C)C(c2c(OC(C)=O)cc(CCCCC)cc2)CC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -18.353
InChIKey:CFYQLKSDGDALED-UHFFFAOYSA-N
ID: 42327
SMILES:c1(O)c(C2C(C(CO)=C)CCC(CO)=C2)c(O)cc(CCCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.651
InChIKey:CEHGPTXEHCVGHY-UHFFFAOYSA-N
ID: 42328
SMILES:c12cc(CCCCC)cc(O)c1C1C=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: 42329
SMILES:C1=CC(C(C)C)C(c2c(O)cc(CCC)cc2O)CC1=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.302
InChIKey:PCCAXFPFFVZBTN-UHFFFAOYSA-N
ID: 42330
SMILES:C(C12c3c(O)cc(CCC)cc3OC3(C(OC)CC1C3(C)C)O2)(=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -12.613
InChIKey:IDYMMEPJHXMARZ-UHFFFAOYSA-N
ID: 42331
SMILES:C12C(C=C(C)CC1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 42332
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 42333
SMILES:C1=C(C)CC2C(C3(C)OC(CC3)C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.406
InChIKey:HVSXDJKAGLUVPZ-UHFFFAOYSA-N
ID: 42334
SMILES:C1(C)(C)Oc2c(cc(O)cc2)C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 42335
SMILES:C1(C)(C)C2C(=CC3(C)CC(OC(c4c(C)cc(O)cc4O)=O)C3C(C)=CC2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -16.438
InChIKey:YHWDNIYTOYVGHC-UHFFFAOYSA-N
ID: 42336
SMILES:C1(=O)C(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.806
InChIKey:WTELYMUFHVDKOR-UHFFFAOYSA-N