ID: 62560
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCCC)c3)C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 62561
SMILES:C1(C(C)=C)C(c2cc(CCCCC)ccc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.247
InChIKey:IJXLDZIYGDHKBA-UHFFFAOYSA-N
ID: 62562
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 62563
SMILES:Cc1ccc2c(c1)OC(CCC1C(C)(C)O1)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -16.33
InChIKey:YTRLVCOIEFWOHP-UHFFFAOYSA-N
ID: 62564
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 62565
SMILES:C12c3c(O)cc(CCCCC)cc3OC3C1(C)CCC1C(C)(C)CCCC13C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: Not available
InChIKey:QPTBCQPMLWUNIE-UHFFFAOYSA-N
ID: 62566
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 62567
SMILES:OC12C(c3c(cc(CCCCC)cc3OC)OC1(C)C)C(O)=C(C(CC=C(C)C)O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -15.929
InChIKey:SKYQUMHRYSKUMO-UHFFFAOYSA-N
ID: 62568
SMILES:CC(=Cc1c(O)cc(OC)c2c1OC(C)(C)C1CCC(C)C(=O)C12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.553
InChIKey:KZIDQARCHKNRHS-UHFFFAOYSA-N
ID: 62569
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 62570
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 62571
SMILES:Oc1cc(C)cc2c1C(C)CC1(OC(C)(C)C3C(C)(C)C(O)C13)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.217
InChIKey:HROKEIHYSVPNRF-UHFFFAOYSA-N
ID: 62572
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 62573
SMILES:C(CCC)CCCCCc1cc2c(c(O)c1)C(=O)C1C(O)(CCC(O)C1(C)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -15.257
InChIKey:WAVZFPARLGDRFN-UHFFFAOYSA-N
ID: 62574
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 62575
SMILES:c1c(CCCCC)cc2c(c1O)C1C(CC(C(O)=O)=CCC1)C(=O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -15.554
InChIKey:OTEONTFUJXOYQH-UHFFFAOYSA-N
ID: 62576
SMILES:C(C)(CCC1=CC(OC)C2C(OC)CC13Cc1c(O)cc(CCCCC)cc1OC23)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.552
InChIKey:OMWATAIHCUYNIN-UHFFFAOYSA-N
ID: 62577
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(OC)ccc(CC(=O)O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.391
InChIKey:BXRHHPFNVPHPFU-UHFFFAOYSA-N
ID: 62578
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1C2CC(C)(O)C(Cl)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.93
CB1 binding score: -14.247
InChIKey:DQZZMUCWEGFKSU-UHFFFAOYSA-N
ID: 62579
SMILES:O=C(c1cc2c(cc1CCCCC)OC(C)(C)C1C2C=C(C(OC)=O)CC1)P(OCC)(OCC)=S
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.644
CB1 binding score: -13.794
InChIKey:YPESLQYAPGDGHQ-UHFFFAOYSA-N
ID: 62580
SMILES:C12C(C)CCC1C(O)c1c(cc(CCCCC)c(C(=O)O)c1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -16.105
InChIKey:LMSKOMPNUHAQTD-UHFFFAOYSA-N