ID: 84211
SMILES:C1(=O)C(=C(C)C)CCC(C)(Oc2cc(CCCCC)cc(O)c2C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.342
InChIKey:NDNYXVBCMMVTDV-UHFFFAOYSA-N
ID: 84212
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 84213
SMILES:CC1CCC2Cc3c(cc(CCCCC)cc3O)OC(C1(C)O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -12.82
InChIKey:JEAFNAKXNUOCQE-UHFFFAOYSA-N
ID: 84214
SMILES:c1(CCCCC)cc(OC2CC(C)=CCCC(C)=CCC(C)(C)C=C2)c(O)c(CC=C(C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.734
CB1 binding score: -17.959
InChIKey:NXGLJENKLLHWQI-UHFFFAOYSA-N
ID: 84215
SMILES:C1(C)(C)OC(CCC(C)=CCc2c(O)c(C(=O)O)c(C(C)C)cc2O)=C(C)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.265
InChIKey:MGHDTOWCEHUWDC-UHFFFAOYSA-N
ID: 84216
SMILES:O(c1c(OC)c(O)cc(CCc2cc(O)cc3c2CCC(C)(CCC=C(CCC=C(C)C)C)C3)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.7
CB1 binding score: -15.05
InChIKey:CRFVXKFTVMPQON-UHFFFAOYSA-N
ID: 84217
SMILES:C1=C(C)CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 84218
SMILES:C(CCCc1cc2c(c(O)c1C(OC)=O)OC(CCC=C(C)C)(C)C1C2=C(C)CCC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -15.454
InChIKey:GXJPRTUXBRTZOH-UHFFFAOYSA-N
ID: 84219
SMILES:C1=C2C(=O)C3(CC(C)(C)CC3C=C1C(CC1(C)Oc3c(c(O)cc(C)c3)C(C)C1)=O)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.641
CB1 binding score: -14.119
InChIKey:OJLSJRZPZNSGRW-UHFFFAOYSA-N
ID: 84220
SMILES:C1CC(C)=CCC2C(C)(C)Oc3cc(C)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.327
InChIKey:WYZHXZAPHHLIGL-UHFFFAOYSA-N
ID: 84221
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 84222
SMILES:C12(O)c3c(O)cc(C(C(C)CC)=O)c(O)c3OC(C)(C)C1CCC(O)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.465
CB1 binding score: -15.459
InChIKey:VTPUIVAENNVJJJ-UHFFFAOYSA-N
ID: 84223
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(OC)=O)=CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -18.065
InChIKey:MYWNNBHNJDCHPP-UHFFFAOYSA-N
ID: 84224
SMILES:O=C(C)Oc1cc(CCCCC)cc2c1C1C(C(C)(O)CO1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -13.465
InChIKey:KJWZHJGSEQKFPK-UHFFFAOYSA-N
ID: 84225
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)O)CCC12O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -17.925
InChIKey:JCKUAAZAONRASP-UHFFFAOYSA-N
ID: 84226
SMILES:C(CCCCCC)CCc1cc(O)c(C2C(C(C)=C)CC=C(CO)C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -17.139
InChIKey:PKKZJOXAEDTQOQ-UHFFFAOYSA-N
ID: 84227
SMILES:C1(C)(CCC=C(C)C)Oc2c(O)cc(CCCCC)cc2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.028
InChIKey:BNDLCGBREIIGHD-UHFFFAOYSA-N
ID: 84228
SMILES:C1(C(O)=O)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 84229
SMILES:c1(O)c2c(cc(CCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 84230
SMILES:O1CC(C)C(C)CC1c1c(O)c2c(cc1C)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.095
InChIKey:MLIWLKVMTDXTKU-UHFFFAOYSA-N
ID: 84231
SMILES:C1CC2(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.525
InChIKey:GRWVPJWZIWHJIU-UHFFFAOYSA-N