ID: 89713
SMILES:CC1(C)CCCC2(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.528
InChIKey:RUNFDTKOHGWARR-UHFFFAOYSA-N
ID: 89714
SMILES:O=C(c1ccc2c(c1-c1c(O)ccc(CCCCC)c1)OC(C)(C)C1C2C=C(C)C(O)C1)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -17.07
InChIKey:HYOQXCZHPWZLIW-UHFFFAOYSA-N
ID: 89715
SMILES:Cc1c(CCCCC)cc(O)c2c1OC1(C(O)C(C)(O)CCC1C(C)(O)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.536
CB1 binding score: -14.086
InChIKey:MMICOANEEPHHQX-UHFFFAOYSA-N
ID: 89716
SMILES:O(C)c1c(O)c(OC)c(C=O)c2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -15.732
InChIKey:AVERQSNGIVMHAC-UHFFFAOYSA-N
ID: 89717
SMILES:C(CCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -19.71
InChIKey:SFWRRSGOJSILSQ-UHFFFAOYSA-N
ID: 89718
SMILES:c12c(c(CCCCC)cc(O)c1)OC(CCC=C(C)C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -18.762
InChIKey:QBPBXWGYZILEJX-UHFFFAOYSA-N
ID: 89719
SMILES:C(=O)(C)OC1C2(C)OC2C2Oc3c(c(OC)cc(CCC)c3)C(C(=C)C)C2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -15.449
InChIKey:NWLGUZNEFGELQN-UHFFFAOYSA-N
ID: 89720
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(CCCCC)cc(OC(C(C)=CC)=O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.844
InChIKey:MGTPUZKBZNMTES-UHFFFAOYSA-N
ID: 89721
SMILES:COc1c2c(cc(CCCCC)c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -19.589
InChIKey:CWOKQYMTXTXLDW-UHFFFAOYSA-N
ID: 89722
SMILES:c1c(O)c2c(cc1CCCCC)OC(CCC(C(C)(C)O)C)C2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -15.929
InChIKey:GRFLPYKJUIBPPJ-UHFFFAOYSA-N
ID: 89723
SMILES:C1(OC(=O)C(C)C)C2C(C)(CCCC(C(O)=O)C)C(O)CCC2(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.691
CB1 binding score: -14.812
InChIKey:BENSPNYGZYZHBH-UHFFFAOYSA-N
ID: 89724
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)=C)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -16.885
InChIKey:ZGTZBRKFZJGQFD-UHFFFAOYSA-N
ID: 89725
SMILES:CC(C(O)C(C)C=C(C)C=CC)(C)c1cc2c(c(O)c1)C1CC(C(=O)O)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -13.232
InChIKey:SZJPVAQCMHXLMM-UHFFFAOYSA-N
ID: 89726
SMILES:C1(C)(O)CC(c2c(O)cc(CCCC)cc2O)OC1CC(C)=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -14.795
InChIKey:QHSJKARMIMEVJP-UHFFFAOYSA-N
ID: 89727
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(O)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 89728
SMILES:C(C)CCc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.137
InChIKey:NEEDPEBKBOSZSS-UHFFFAOYSA-N
ID: 89729
SMILES:C(Cc1c2c(c(O)c(C)c1)OC(C)(C)C1C2CC(C)=CC1)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.825
InChIKey:CABQMPNHFBPRIM-UHFFFAOYSA-N
ID: 89730
SMILES:C1(O)(C)C2C3C(CC1)C(C)(C)Oc1c(c(O)cc(CCCCC)c13)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.227
InChIKey:ZFIHZEYZGYYFOA-UHFFFAOYSA-N
ID: 89731
SMILES:C1=C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.875
InChIKey:MABLLFKQVKWWPG-UHFFFAOYSA-N
ID: 89732
SMILES:C(O)C1(C)C(Cc2c(O)cc(CCCCC)cc2O)C2(C)CCC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.363
InChIKey:SHBUEVLBBSEKMK-UHFFFAOYSA-N
ID: 89733
SMILES:C1(C)(C)C2CC(=O)C(C)=CC1c1c(cc(CCCCC)cc1OC)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.265
InChIKey:SDUSSZZXNBBDDH-UHFFFAOYSA-N