ID: 129592
SMILES:C(CCc1cc2c(c(O)c1)C1CC(C(=O)O)(C)CC(=O)C1(C)C1C(C)(O2)c2c(c(O)ccc2)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.612
CB1 binding score: -15.845
InChIKey:JRNMKZWSZDHSRH-UHFFFAOYSA-N
ID: 129593
SMILES:C1(=O)CC2C(C(C)(C)Oc3cc(C)c(Br)cc32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 309.203
CB1 binding score: -17.769
InChIKey:XOLCPJBEWRABHC-UHFFFAOYSA-N
ID: 129594
SMILES:C(OC1C(C)C(=O)c2c(c(O)c(C)cc2OC)C1(C(=C)CO)c1c(O)cc(CCCCC)cc1O)(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.643
CB1 binding score: -15.519
InChIKey:WWDPKPKHIYJNKG-UHFFFAOYSA-N
ID: 129595
SMILES:C1C(C(O)(C)C)OC(c2c(O)cc(CCCCC)cc2O)C(C=C)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -11.54
InChIKey:QTUDVZLTLWIXSR-UHFFFAOYSA-N
ID: 129596
SMILES:C(O)c1cc(C2C=C(C)CCC2C(=C)C)c(O)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.397
InChIKey:KMCXVDOHJASLKB-UHFFFAOYSA-N
ID: 129597
SMILES:O1C2(O)C(=O)C(C)=CC1c1c(cc(CCCCC)cc1OC(C)=O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -15.831
InChIKey:MZCZHEQYAISNFS-UHFFFAOYSA-N
ID: 129598
SMILES:c1(C2C(C(C)(C)OC)CCC(C)=C2)c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -16.145
InChIKey:AAKMUXZVEJTIOR-UHFFFAOYSA-N
ID: 129599
SMILES:CC1(C)Oc2cc(C=CC=O)cc(OC)c2C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -17.952
InChIKey:NMEIWEYLCCWRBQ-UHFFFAOYSA-N
ID: 129600
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1)(OC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 129601
SMILES:C(CC)CCc1cc2c(c(O)c1)C1CC(C)=CC(=O)C2(C)CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -11.814
InChIKey:HPQHECYJVWDOMF-UHFFFAOYSA-N
ID: 129602
SMILES:C12C(C)(CCC(C)C13Oc1c(c4ccccc4c(C)c1CC)OC2(C)C)Oc1cc(OC)cc(C)c1C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.679
CB1 binding score: -15.374
InChIKey:XSRHWCVWZFTBLX-UHFFFAOYSA-N
ID: 129603
SMILES:CC(=O)C=C1C(=O)OC2(C)C3C(=CCC2(C)C1)C(C)=C1C(=O)C(OCC)=C(C)C1=C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.494
CB1 binding score: -15.369
InChIKey:ZUDNDWUWORKOIA-UHFFFAOYSA-N
ID: 129604
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(COC(C)=O)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N
ID: 129605
SMILES:C1(C)(C)Oc2cc(CCCCC)ccc2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.367
CB1 binding score: -17.198
InChIKey:XFFCNLHLJADNLV-UHFFFAOYSA-N
ID: 129606
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 129607
SMILES:C1C2(C)Oc3cc(CCCCC)cc(O)c3C3C(C(=C)C)CCC1(C)C3C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -12.955
InChIKey:DMEKUNMPXIHHEO-UHFFFAOYSA-N
ID: 129608
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 129609
SMILES:C(=C(C)C)CCC(=CCOc1ccc(C2C=C(C)CCC2C(C)(C)O)c(O)c1OC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.309
InChIKey:UVFNFDBIDMGISV-UHFFFAOYSA-N
ID: 129610
SMILES:C1C2C(C=C(C)C1)c1ccc(C)c(C(=O)O)c1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -16.219
InChIKey:YBDMVZSRRKIWJW-UHFFFAOYSA-N
ID: 129611
SMILES:c1c(CCN(C)C)cc(C2C(C(=C)C)CCC(C)=C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 283.459
CB1 binding score: -18.316
InChIKey:NCZMJELKEZQIFV-UHFFFAOYSA-N
ID: 129612
SMILES:Brc1c(O)c(C2C(C(=C)C)CCC(C)=C2)c(C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 337.257
CB1 binding score: -16.278
InChIKey:QPCONHIMZXWXIH-UHFFFAOYSA-N