ID: 112750
SMILES:c1(OC)c(C2C(C(=C)C)CCC(C)=C2)cc(O)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.742
InChIKey:GBNCVURGFWWDAT-UHFFFAOYSA-N
ID: 112751
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: 112752
SMILES:C(c1c(O)cc2c(c1C)CC(CCC=C(C)C)(C)O2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.283
InChIKey:QKBICLMNPOLDQW-UHFFFAOYSA-N
ID: 112753
SMILES:C(CC)CCc1c2c(cc(O)c1C)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.752
InChIKey:JUYYXDHALCUBRJ-UHFFFAOYSA-N
ID: 112754
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.334
InChIKey:LMTQDQLMOBKYNY-UHFFFAOYSA-N
ID: 112755
SMILES:C(CCC1(C)C=Cc2c(O)cc(CCc3cc(O)c(O)cc3)cc2O1)C1C(CCC=C(C)C)(C)CCC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 530.749
CB1 binding score: -17.042
InChIKey:ZIGYSGVOVSUBGX-UHFFFAOYSA-N
ID: 112756
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 112757
SMILES:C(=O)(c1c(O)c2c(cc1)OC(C)(C)C1C2CC(C=O)=CC1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.326
CB1 binding score: -16.336
InChIKey:DXOCQBRVTBZWJU-UHFFFAOYSA-N
ID: 112758
SMILES:c1(CCCCC)c(CC=C(C)C)cc(O)c(CC=C(C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -15.45
InChIKey:MVVAPYFKIYSJJP-UHFFFAOYSA-N
ID: 112759
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -19.594
InChIKey:GBBIYEKUPBZPNQ-UHFFFAOYSA-N
ID: 112760
SMILES:C(O)(C)CCCc1cc2c(c(O)c1)C(=O)CC(C)(CC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.166
InChIKey:VZPKZSGVSUJOQN-UHFFFAOYSA-N
ID: 112761
SMILES:Oc1cc(C)c(C2C(C(=C)C)CCC(C)=C2)c(OC)c1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.929
InChIKey:TYGKQWLNDQHTDU-UHFFFAOYSA-N
ID: 112762
SMILES:CC(CCCCC)CCCC(c1c(O)c(C2C=C(C)CCC2C(C)=C)c(O)c(O)c1OC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.683
CB1 binding score: -14.767
InChIKey:QSNIGSUARURCFY-UHFFFAOYSA-N
ID: 112763
SMILES:Oc1c(C2CC(=C)CCC2C(C)=C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.279
InChIKey:KLYPAQJXUITNGB-UHFFFAOYSA-N
ID: 112764
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 112765
SMILES:CC1(C)OC1CC12OC(C)(C)C3CC(=O)OC(C)(C)C1(C3=C)Cc1c2nco1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 387.476
CB1 binding score: -14.452
InChIKey:KYDLCEHJMDQUJI-UHFFFAOYSA-N
ID: 112766
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC1(C)OC1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -18.982
InChIKey:CKPQLRBRCDKZHC-UHFFFAOYSA-N
ID: 112767
SMILES:C1(C)(CNC(C(OC)=O)C)C2CCC(C)=CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 415.574
CB1 binding score: -15.67
InChIKey:HJNXNWZNNZBLOE-UHFFFAOYSA-N
ID: 112768
SMILES:c1(C2C(C(C)C)CCC(C)=C2)c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.957
InChIKey:XFYKOYWZVVGAEV-UHFFFAOYSA-N
ID: 112769
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(=C)C)C3C(C(C)CC1)C2(C)CC3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -15.47
InChIKey:KCYFSJMHDOQLRJ-UHFFFAOYSA-N
ID: 112770
SMILES:C1C(C)CCCC(C)C(O)C(C)=CCC2C(C)(C)Oc3cc(C)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -13.685
InChIKey:VYEPBHWLOXVJEO-UHFFFAOYSA-N