ID: 35533
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 35534
SMILES:c12c(CCCCC)cc(O)c(C(=O)C(C)C)c1OC1(C)CCC3C(C)(C)CC3C(C)C=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -16.777
InChIKey:DZYVFAHZJQDNQQ-UHFFFAOYSA-N
ID: 35535
SMILES:c1(C(C(=O)C(C)C)C(c2cc(CC=C(C)C)cc(C(C)=O)c2O)=O)cc(OC)c2c(c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 588.741
CB1 binding score: -16.521
InChIKey:HJRVZDXXFRPBIZ-UHFFFAOYSA-N
ID: 35536
SMILES:C(=C(C)C(=O)OCc1ccccc1O)c1cc2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.668
CB1 binding score: -13.504
InChIKey:LOEONGGANQUWGD-UHFFFAOYSA-N
ID: 35537
SMILES:CC1=C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.524
InChIKey:USODFRMMCODFKQ-UHFFFAOYSA-N
ID: 35538
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 35539
SMILES:O=C(C(=CC)c1c(O)cc(O)c2c1OC(C)(C)C1CCC(C)=CC21)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -16.079
InChIKey:XCSTVBXWYBVDOK-UHFFFAOYSA-N
ID: 35540
SMILES:C1(C)(C)Oc2c(Br)c(CCC(C(C)(C)O)O)ccc2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 343.261
CB1 binding score: -14.194
InChIKey:SBAFXFGZMFZQRP-UHFFFAOYSA-N
ID: 35541
SMILES:c1(CCCCC)cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 35542
SMILES:CC(=CCCC(=CCc1c(O)c(C(=O)O)c(CCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -19.667
InChIKey:FAVCTJGKHFHFHJ-UHFFFAOYSA-N
ID: 35543
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 35544
SMILES:C1C(=O)C(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.408
InChIKey:ONQDXXIDBPYBFF-UHFFFAOYSA-N
ID: 35545
SMILES:C1C2C(C)(CCC(=O)C2(C)C(=O)O)Cc2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -12.271
InChIKey:QCJAHRVIDNFCPT-UHFFFAOYSA-N
ID: 35546
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC(O)(C)C2C1(C)C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.806
InChIKey:RNLRBSYNLYMOBP-UHFFFAOYSA-N
ID: 35547
SMILES:C(CCCC)c1cc(O)c2c(c1O)C1CC(C)(O2)CCC1=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.011
InChIKey:JFVSMWPJVIJXJM-UHFFFAOYSA-N
ID: 35548
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 35549
SMILES:O(C(C)=O)CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -17.205
InChIKey:OCHIAXLVXWKVLD-UHFFFAOYSA-N
ID: 35550
SMILES:c1(Cl)c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)(O)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.929
CB1 binding score: -18.118
InChIKey:NVBOIKZKQPHDHH-UHFFFAOYSA-N
ID: 35551
SMILES:c12cc(O)c3c(c1C(OC)C(c1cc(O)c(C(C)(C)O)cc1C)O2)OC(C)(C)C1CCC(C)=CC13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.601
CB1 binding score: -15.971
InChIKey:PUTNUGPCSPYNTG-UHFFFAOYSA-N
ID: 35552
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.895
InChIKey:IURVSOIKWDDGMH-UHFFFAOYSA-N
ID: 35553
SMILES:COc1c(OC)c(CCCC)cc2c1OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -14.517
InChIKey:TWFFPLXDOFJFGB-UHFFFAOYSA-N