ID: 65773
SMILES:C1(C=C(C)C)c2cc(CCCCC)cc(O)c2C2C(C)(OCC2CCC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -15.087
InChIKey:BLNHTOSFGMKHOG-UHFFFAOYSA-N
ID: 65774
SMILES:Oc1ccc(CCCCCC)c2c1C1CC(=C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.636
InChIKey:PQSTWNQIZLBDFB-UHFFFAOYSA-N
ID: 65775
SMILES:c12c(cc(CCCCCC)cc1O)C(OC)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -13.815
InChIKey:XKKNKQTXHCFYKF-UHFFFAOYSA-N
ID: 65776
SMILES:c1(CCCCC)cc(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 65777
SMILES:O1C23C(CC(OCC)Oc4cc(CCCCC)cc(O)c42)C1(C)CCC3OC(=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -15.987
InChIKey:WFTYRUBFXDHOOU-UHFFFAOYSA-N
ID: 65778
SMILES:O(CC)C(C1C2(C(C)(C)Oc3cc(CCCCC)cc(O)c31)C=C(C)CC2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.797
InChIKey:XHSJEUWKGCXBLC-UHFFFAOYSA-N
ID: 65779
SMILES:Oc1c2c(c(C(C(C)CC)=O)c(OC)c1)OC(C)(C)C1C2C=C(C(=O)OC)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -15.177
InChIKey:SFFLLNGCEXKXOG-UHFFFAOYSA-N
ID: 65780
SMILES:C1C(C(=C)C)C(c2c(O)cc(CC)cc2O)C(=O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.575
InChIKey:PLVFFKCMLCAUEI-UHFFFAOYSA-N
ID: 65781
SMILES:c12c(cc(C(C)(C)C(O)CCCCCCC)cc1O)OC(CCC=C(C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.664
InChIKey:ONAGXYVSDXPHGI-UHFFFAOYSA-N
ID: 65782
SMILES:c1(C(O)=O)c(CCCCC)cc(O)c2c1OC1(C)CCC(C(C)C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.418
InChIKey:UIPAFBCEVMQSQP-UHFFFAOYSA-N
ID: 65783
SMILES:CC(=CC)C(=O)Cc1c2c(ccc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.326
InChIKey:XSCCZZOFTUWDEA-UHFFFAOYSA-N
ID: 65784
SMILES:C1CCC(C)(C)C(Cc2c(O)cc(CCC)cc2O)C1=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.577
InChIKey:BMTPYSHZIUGILX-UHFFFAOYSA-N
ID: 65785
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.691
InChIKey:RDLVEYAULHYSIG-UHFFFAOYSA-N
ID: 65786
SMILES:C(C)(C)C1C=CC(C)=CC1c1c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.209
InChIKey:LHVRUTHJDYWZQW-UHFFFAOYSA-N
ID: 65787
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1=CCC(O)(C)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.502
InChIKey:YJXCCTXJUJKUKB-UHFFFAOYSA-N
ID: 65788
SMILES:O=C(OCC)c1c(CCCC)cc(O)c(CC=C(C)CCC=C(CCC=C(C)C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -14.426
InChIKey:PCGJRNCUGMVQFW-UHFFFAOYSA-N
ID: 65789
SMILES:C1CCC(C)(C)C(CC(=CCc2c(O)c(C)cc(O)c2)C)=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.729
InChIKey:PRKDRFJWNDPFAD-UHFFFAOYSA-N
ID: 65790
SMILES:C1CC(CCC=C(C)C)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 65791
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 65792
SMILES:C(CC)CCc1ccc(O)c2c1OC(C)(C)C1CC3C(C)(O3)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.048
InChIKey:CMGQGOFNCWNUOE-UHFFFAOYSA-N
ID: 65793
SMILES:c1(C)cc(O)c2c(c1CCCCC)OC(C)(C)C1CCC(C)(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.952
InChIKey:KBYLLJBRQCVHCO-UHFFFAOYSA-N