ID: 74698
SMILES:c1(CCCCC)cc(O)c(CC=C(CCC=C(C)C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 74699
SMILES:C1(CCC(C)=O)C(C)(C)Oc2cc(CCCCCO)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -16.306
InChIKey:JVJZEUNNKVYRCT-UHFFFAOYSA-N
ID: 74700
SMILES:NCCc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 355.522
CB1 binding score: -14.626
InChIKey:KLVYGHDKSWEPSB-UHFFFAOYSA-N
ID: 74701
SMILES:CC1(C)C2CCC(CO)=CC2c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.668
InChIKey:ULAFKXIIRFYROC-UHFFFAOYSA-N
ID: 74702
SMILES:Cc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.387
InChIKey:VVRJCBBASZRUGL-UHFFFAOYSA-N
ID: 74703
SMILES:CC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 74704
SMILES:C(CC)CCc1cc(O)c(CC=C(CCC=C(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: 74705
SMILES:C1=C(C)C(=O)CC2C1c1c(cc(CCCCC)c(C(O)=O)c1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -18.072
InChIKey:YOOZEGHUCWMIKR-UHFFFAOYSA-N
ID: 74706
SMILES:C1=CC(C)(C)Oc2c(cc(CCCCC)cc2O)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.526
InChIKey:DYFZCICCSSLMNK-UHFFFAOYSA-N
ID: 74707
SMILES:C12=CC(=O)C(C)(C)OC13C(CCC3C)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -14.801
InChIKey:YZMUQPUXKSZXTD-UHFFFAOYSA-N
ID: 74708
SMILES:CC(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: 74709
SMILES:C1C2C(C)=CCC(C(=C)C)C2c2c(O)c(C=O)c(CCCCC)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -12.279
InChIKey:DFYKKDFXQFMIBO-UHFFFAOYSA-N
ID: 74710
SMILES:Oc1c(C2C(C(C)=C)CCC(C)=C2)ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.171
InChIKey:HFDMGJLGHZDMNB-UHFFFAOYSA-N
ID: 74711
SMILES:C=C(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 74712
SMILES:C(CCCC)c1cc(OC(=O)CCc2cc(OC)c(O)cc2)c(OC)c2c1C1=C(CO)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.654
CB1 binding score: -17.011
InChIKey:TULADHGYQYLAAV-UHFFFAOYSA-N
ID: 74713
SMILES:C(=O)(C=Cc1c(CCCCC)cc2c(c1O)C=CC(CCC1C(C)(C)O1)(C)O2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -14.605
InChIKey:CAXNPRSDXLXMDD-UHFFFAOYSA-N
ID: 74714
SMILES:C(C(O)c1cc(O)c2c(c1)OC(C(C)(C)O)C2)C=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.888
InChIKey:XMRGWLGFKXTTHN-UHFFFAOYSA-N
ID: 74715
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)C)C(C)=C(O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -15.519
InChIKey:PDSIIVVQSBLQEI-UHFFFAOYSA-N
ID: 74716
SMILES:O1c2c(c(O)cc(CCCCC)c2)C23C(C)CCC(C(C)C)C2C13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.553
InChIKey:NTBZXRJWHRDEMD-UHFFFAOYSA-N
ID: 74717
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCC)c2)C2C=C(C(O)=O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17
InChIKey:CGYHWLVCHKZQHO-UHFFFAOYSA-N
ID: 74718
SMILES:C1C2C(c3c(cc(CCCCC)cc3O)OC2(C)CCC=C(C)C)=CC(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -16.066
InChIKey:WALOHXYNGZSGDQ-UHFFFAOYSA-N